3-(4-bromobenzene-1-sulfonyl)-N-[3-(methylsulfanyl)phenyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine
Chemical Structure Depiction of
3-(4-bromobenzene-1-sulfonyl)-N-[3-(methylsulfanyl)phenyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine
3-(4-bromobenzene-1-sulfonyl)-N-[3-(methylsulfanyl)phenyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine
Compound characteristics
| Compound ID: | C718-2735 |
| Compound Name: | 3-(4-bromobenzene-1-sulfonyl)-N-[3-(methylsulfanyl)phenyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine |
| Molecular Weight: | 526.43 |
| Molecular Formula: | C22 H16 Br N5 O2 S2 |
| Smiles: | CSc1cccc(c1)Nc1c2ccccc2n2c(c(nn2)S(c2ccc(cc2)[Br])(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.8917 |
| logD: | 5.8917 |
| logSw: | -5.9742 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.295 |
| InChI Key: | QYBQAYVXUFDNQJ-UHFFFAOYSA-N |